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Dimensional crossover of correlated anion disorder in oxynitride perovskites
Cif and data files (.gss format) for powder structure refinements of Ba1-xSrxTaO2N materials at 300 K using the GSAS software package. Ba/Sr contents are indicated in the file names.
Lock-in spin structures and ferrimagnetism in polar Ni2-xCoxScSbO6 oxides
All data are for the paper published in Chem Comm 2018.
Powder X-ray and neutron diffraction datasets and cif crystallographic files.
Magnetisation vs temperature or field data.
Ca Double Double and Double Triple Perovskites
Complex Ferrimagnetism and Magnetoresistance Switching in Ca-based Double Double and Triple Double Perovskites.
We have used high pressures and temperatures to synthesize the cation ordered AA′BB′O6 perovskites CaMnFeReO6, ...
Preparation of iron(IV) nitridoferrate Ca4FeN4 through azide-mediated oxidation under high-pressure conditions
Data from characterisation of the title compound; Magnetic, Mossbauer, Neutron and X-ray diffraction results
Co-emergence of magnetic order and structural fluctuations in magnetite
Data are to accompany the publication 'Co-emergence of magnetic order and structural fluctuations in magnetite' by G. Perversi et al, Nature Communications 2019.
Data are;
.dat files, intensity vs. two theta for input ...
Structural study of the pressure-induced metal-insulator transition in LiV2O4
.xy files (intensity vs. 2theta) for the diffraction patterns of LiV2O4. Temperature and pressure for each datset are shown in the file title. Data is support of manuscript: Structural study of the pressure-induced ...
Mn2MnReO6 ChemComm2016
Structural and magnetic data for Mn2MnReO6, supporting a paper submitted to Chemical Communications.
Ferri- and ferro- magnetism in CaMnMReO6 double double perovskites of late transition metals M = Co and Ni
Magnetisation data, powder neutron diffraction, and powder x-ray diffraction results for the title compounds at variable temperatures.
RCrO3-xNx ChemComm 2016
Low temperature powder neutron diffraction data files and cif files used for crystal and magnetic structure refinements for RCrO3-xNx materials where R = La, Pr, Nd.
MnRMnSbO6 Angew Chem 2016
Crystallographic data supporting the publication: "MnRMnSbO6" Attfield et al, Angew. Chem. (In Submission).
MnFe3O5 ZAAC 2016
Data from magnetisation and XRD measurements supporting Attfield JP et al 2016 ZAAC (Zeitschrift für anorganische und allgemeine Chemie) (Accepted manuscript).
Long range electronic phase separation in CaFe3O5
Data are to accompany 'Long range electronic phase separation in CaFe3O5', by K. H. Hong et al, Nature Communications (2018).
Details of data files;
(1) D2 instrument powder X-ray diffraction - cif file and data file for ...
Complex cation and spin orders in the high pressure ferrite CoFe3O5
Data are for the paper 'Complex cation and spin orders in the high pressure ferrite CoFe3O5' by Ka. Hong et al, Inorg. Chem. (2018)
Details of the files are in README.txt
Persistent three- and four-atom orbital molecules in the spinel AlV2O4
Electronic instabilities in transition metal compounds may lead to ground states containing orbital molecules when direct metal-metal orbital interactions occur. The spinel AlV2O4 was reported to contain V717+ orbital ...
Frustration wave order in iron(II) oxide spinels
Files are:
Powder neutron and X-ray data files for Fe2GeO4 and Fe2SiO4 with different temperatures and take off angles as indicated in the file titles. Files are standard types generated by FullProf software.
Data ...
Orbital molecules in the new spinel GaV2O4
Data to accompany;
Orbital molecules in the new spinel GaV2O4
Alexander J. Browne, Calum Lithgow, Simon. A. J. Kimber, and J. Paul Attfield
Inorg. Chem. 2018
Data are;
cif files
HRPD neutron data at various ...
Site-selective doping of ordered charge states in magnetite
cif (Crystallographic Information File) files for the 3 single crystal analyses in this study.
Crystal 1 - xtal6_final.cif
Crystal 2 - ep38_dp01_x7_fc_fsxmia2RE.cif
Crystal 3 - best_r.cif
Unconventional magnetism in the high pressure ‘all transition metal’ double perovskite Mn2NiReO6
Standard crystallography files (cif format and data in gss format) for refinements of the title material at different temperatures as indicated by the filenames. Also some plotted results data in opj format.
